4-(3-methyl-5-phenyl-pyrazol-1-yl)benzenecarbonitrile

Systemtic Name: 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzenecarbonitrile Openeye Name: 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzonitrile CAS Name: 4-(3-methyl-5-phenyl-1-pyrazolyl)benzonitrile IUPAC Name: 4-(3-methyl-5-phenylpyrazol-1-yl)benzonitrile Traditional Name: 4-(3-methyl-5-phenyl-pyrazol-1-yl)benzonitrile Formula: C17H13N3 MolecularWeight: 259.30522

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H13N3/c1-13-11-17(15-5-3-2-4-6-15)20(19-13)16-9-7-14(12-18)8-10-16/h2-11H,1H3